4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methyl-piperazin-1-ium iodide

Systemtic Name: 4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methyl-piperazin-1-ium iodide Openeye Name: 4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methyl-piperazin-1-ium iodide CAS Name: 4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methylpiperazin-1-ium iodide IUPAC Name: 4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methylpiperazin-1-ium iodide Traditional Name: 4-[bis(4-chlorophenyl)methyl]-1-ethyl-1-methyl-piperazin-1-ium iodide Formula: C20H25Cl2IN2 MolecularWeight: 491.23637

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCN(CC1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C.[I-]

Isomeric SMILES

CC[N+]1(CCN(CC1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C.[I-]

InChI

InChI=1S/C20H25Cl2N2.HI/c1-3-24(2)14-12-23(13-15-24)20(16-4-8-18(21)9-5-16)17-6-10-19(22)11-7-17;/h4-11,20H,3,12-15H2,1-2H3;1H/q+1;/p-1